CID 56843270

26765-68-4

Structural Information

Molecular Formula
C17H16O
SMILES
C1CC2=C3C(=CC=C2)C4=CC=CC=C4C3(C1)CO
InChI
InChI=1S/C17H16O/c18-11-17-10-4-6-12-5-3-8-14(16(12)17)13-7-1-2-9-15(13)17/h1-3,5,7-9,18H,4,6,10-11H2
InChIKey
REEDTDAAIXYAOV-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-fluoranthen-6a-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.12012 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.127396 153.8
[M+Na]+ 259.109338 162.3
[M-H]- 235.112844 158.1
[M+NH4]+ 254.153943 178.1
[M+K]+ 275.083278 156.1
[M+H-H2O]+ 219.117380 147.4
[M+HCOO]- 281.118321 171.8
[M+CH3COO]- 295.133971 166.1
[M+Na-2H]- 257.094786 161.3
[M]+ 236.11957142 153.1
[M]- 236.12066858 153.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.